| SpectraBase Compound ID | EwUCYPrtfAq |
|---|---|
| InChI | InChI=1S/C16H32ClNO/c1-3-5-7-9-11-13-18(16(19)15-17)14-12-10-8-6-4-2/h3-15H2,1-2H3 |
| InChIKey | ZOFPQFIAAZHFAY-UHFFFAOYSA-N |
| Mol Weight | 289.9 g/mol |
| Molecular Formula | C16H32ClNO |
| Exact Mass | 289.217242 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F579KImhXAG |
|---|---|
| Name | Chloroacetamide, N,N-diheptyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.217242353 u |
| Formula | C16H32ClNO |
| InChI | InChI=1S/C16H32ClNO/c1-3-5-7-9-11-13-18(16(19)15-17)14-12-10-8-6-4-2/h3-15H2,1-2H3 |
| InChIKey | ZOFPQFIAAZHFAY-UHFFFAOYSA-N |
| SMILES | CCCCCCCN(C(CCl)=O)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966586 |